6-methyl-8-[(3-methylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate

Systemtic Name: 6-methyl-8-[(3-methylpiperidin-1-ium-1-yl)methyl]-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Openeye Name: 6-methyl-8-[(3-methylpiperidin-1-ium-1-yl)methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate CAS Name: 6-methyl-8-[(3-methyl-1-piperidin-1-iumyl)methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-olate IUPAC Name: 6-methyl-8-[(3-methylpiperidin-1-ium-1-yl)methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Traditional Name: 4-keto-6-methyl-8-[(3-methylpiperidin-1-ium-1-yl)methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C(=C3C(=C2)C4=C(CCC4)C(=O)O3)C)[O-]

Isomeric SMILES

CC1CCC[NH+](C1)CC2=C(C(=C3C(=C2)C4=C(CCC4)C(=O)O3)C)[O-]

InChI

InChI=1S/C20H25NO3/c1-12-5-4-8-21(10-12)11-14-9-17-15-6-3-7-16(15)20(23)24-19(17)13(2)18(14)22/h9,12,22H,3-8,10-11H2,1-2H3